MOESM1 of An integrated quantitative structure and mechanism of action-activity relationship model of human serum albumin binding

Additional file 1. This file contains the following supplementary tables: Table S1: Dataset; Table S2: Parameters and criteria considered for goodness of fit, internal and external validation; Table S3: External dataset with predicted LogKhsa; Table S4: Molecular descriptors appearing in the models; Table S5: Genes appearing in the models; Table S6: Summary of the models parameters and evaluation metrics.